Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOD1 | Q9Y239 | 5/20 | 0.60 |
| ▸ | OTC | P00480 | 1/20 | 0.59 |
| ▸ | CASP2 | P42575 | 1/20 | 0.55 |
| ▸ | DDAH1 | O94760 | 4/20 | 0.51 |
| ▸ | NOS1 | P29475 | 2/20 | 0.51 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.49 |
| ▸ | GSR | P00390 | 1/20 | 0.44 |
| ▸ | NAAA | Q02083 | 1/20 | 0.43 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.43 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.43 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL16860728 | 1.00 | NOD1 (0.60) | NOD1OTCCASP2DDAH1NOS1 | |
| SCHEMBL20704842 | 0.95 | NOD1 (0.59) | NOD1OTCCASP2DDAH1NOS1 | |
| SCHEMBL13311701 | 0.95 | NOD1 (0.59) | NOD1OTCCASP2DDAH1NOS1 | |
| SCHEMBL1422751 | 0.95 | NOD1 (0.59) | NOD1OTCCASP2DDAH1NOS1 | |
| SCHEMBL16860752 | 0.92 | NOD1 (0.67) | NOD1OTCCASP2DDAH1NOS1 | |
| SCHEMBL16860722 | 0.92 | NOD1 (0.67) | NOD1OTCCASP2DDAH1NOS1 | |
| SCHEMBL16860753 | 0.90 | NOD1 (0.73) | NOD1OTCCASP2DPP7 | |
| SCHEMBL16860725 | 0.90 | NOD1 (0.73) | NOD1OTCCASP2DPP7 | |
| SCHEMBL16860655 | 0.89 | NOD1 (0.52) | NOD1OTCCASP2DDAH1NOS1 | |
| SCHEMBL16860739 | 0.89 | NOD1 (0.76) | NOD1OTCCASP2DPP7NAAA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3087094-A1 | BETA-HAIRPIN PEPTIDOMIMETICS AS SELECTIVE ELASTASE INHIBITORS | Polyphor AG (CH) | 2016-11-02 | — | — | EP | disclosed |
| WO-2015096873-A1 | BETA-HAIRPIN PEPTIDOMIMETICS AS SELECTIVE ELASTASE INHIBITORS | POLYPHOR AG (CH) | 2015-07-02 | — | — | WO | disclosed |